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Compound Detail

CHEMBL5596908

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Cn1cc(-c2cc3c(Oc4ccc(NC(=O)C5(C(=O)Nc6ccc(F)cc6)CC5)cc4)ncnn3c2)cn1

Basic Information

ChEMBL ID CHEMBL5596908
Phase Preclinical
Structure Type MOL
InChI Key MNUPLQVJAOMLAS-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

511.5
MW (Da)
4.42
ALogP
8
HBA
2
HBD
115.4
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H22FN7O3
MW 511.52
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -1.54

Activity Summary

IC50 2 meas. best 7.58

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase receptor UFO
CHEMBL4895
IC50 7.58 7.58 26.0 1
Hepatocyte growth factor receptor
CHEMBL3717
IC50 7.5 7.5 32.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
38733884 10.1016/j.ejmech.2024.116477 Hepatocyte growth factor receptor 1
38733884 10.1016/j.ejmech.2024.116477 Tyrosine-protein kinase receptor UFO 1

Data from ChEMBL 36 via Core Engine